SCHEMBL17065807

SCHEMBL17065807

Brc1ccccc1-c1cc2ccccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.59
CHEK1 O14757 1/20 0.59
RAB9A P51151 4/20 0.59
KDM4E B2RXH2 4/20 0.59
MAPT P10636 4/20 0.59
MEN1 O00255 3/20 0.59
ALDH1A1 P00352 3/20 0.59
HPGD P15428 3/20 0.59
KMT2A Q03164 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
NPC1 O15118 3/20 0.57
FFAR1 O14842 1/20 0.52
USP2 O75604 1/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
GAA P10253 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31544438 1.00 KDR (0.59) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL31544442 1.00 KDR (0.59) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL31544439 1.00 KDR (0.59) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL5051826 0.87 KDR (0.68) KDRCHEK1RAB9AKDM4EMAPT
Methane SCHEMBL28704887 0.85 KDR (0.66) KDRCHEK1RAB9AKDM4EMAPT
Benzene SCHEMBL27629233 0.85 RAB9A (0.69) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL27927203 0.83 MAPT (0.50) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL10176240 0.82 KDR (0.61) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL17065800 0.80 MEN1 (0.63) KDRCHEK1RAB9AKDM4EMAPT
SCHEMBL27927108 0.80 FFAR1 (0.53) RAB9AKDM4EMAPTMEN1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107445989-B Phosphine ligand with indole skeleton and preparation method and application thereof 香港理工大学深圳研究院 2020-05-29 CN claimed
CN-104945434-A (2-disubstituted phosphino-phenyl)-1-alkyl-indol-phosphine ligand and synthetic method and application thereof SHENZHEN RES INST THE HONG KONG POLYTECHNIC UNIVERSITY 2015-09-30 CN claimed
CN-101935297-B 3,3- diindolyl derivative and preparation method thereof UNIV ZHEJIANG 2012-09-05 CN claimed
CN-101935297-A 3,3- diindolyl derivative and preparation method thereof UNIV ZHEJIANG 2011-01-05 CN claimed
CN-111825686-A Oxazepino [3,2-b ] indole compound and synthetic method thereof 贵州医科大学 2020-10-27 CN disclosed
CN-107445989-B Phosphine ligand with indole skeleton and preparation method and application thereof 香港理工大学深圳研究院 2020-05-29 CN disclosed
CN-109438451-A The method of level-one amine guiding building 6- (2- bromophenyl) indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-08 CN disclosed
CN-104945434-B (2 ﹣ bis- substitution phosphines phenyl) -1- alkyl-indols Phosphine ligands and its synthetic method and application 香港理工大学深圳研究院 2018-05-18 CN disclosed
CN-107445989-A A kind of Phosphine ligands of indoles skeleton and its preparation method and application 香港理工大学深圳研究院 2017-12-08 CN disclosed
CN-104892614-B A kind of synthetic method of 6H iso-indoles simultaneously ketone derivatives of [2,1 α] indoles 6 福建师范大学 2017-11-07 CN disclosed
CN-104945434-A (2-disubstituted phosphino-phenyl)-1-alkyl-indol-phosphine ligand and synthetic method and application thereof SHENZHEN RES INST THE HONG KONG POLYTECHNIC UNIVERSITY 2015-09-30 CN disclosed
WO-2015133804-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-09-11 WO disclosed
CN-104892614-A Synthesis method of 6H-isoindolo[2, 1-alpha]indol-6-one derivative UNIV FUJIAN 2015-09-09 CN disclosed
CN-103145710-B The synthetic method of indole-imidazole compound BEIJING UNIVERSITY OF TECHNOLOGY (CN) 2015-08-19 CN disclosed
CN-103145710-A Synthesis method of indole-imidazole compound UNIV BEIJING TECHNOLOGY 2013-06-12 CN disclosed
CN-101935297-B 3,3- diindolyl derivative and preparation method thereof UNIV ZHEJIANG 2012-09-05 CN disclosed
CN-101935297-A 3,3- diindolyl derivative and preparation method thereof UNIV ZHEJIANG 2011-01-05 CN disclosed